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327031-30-1

327031-30-1 Structure

327031-30-1 Structure
IdentificationBack Directory
[Name]

Benzaldehyde, 4-hydroxy-3,5-dimethoxy-, 2-(8-methyl-5H-1,2,4-triazino[5,6-b]indol-3-yl)hydrazone
[CAS]

327031-30-1
[Synonyms]

Benzaldehyde, 4-hydroxy-3,5-dimethoxy-, 2-(8-methyl-5H-1,2,4-triazino[5,6-b]indol-3-yl)hydrazone
[Molecular Formula]

C19H18N6O3
[MOL File]

327031-30-1.mol
[Molecular Weight]

378.39
Chemical PropertiesBack Directory
[Boiling point ]

668.7±65.0 °C(predicted)
[density ]

1.45±0.1 g/cm3(Temp: 20 °C; Press: 760 Torr)(predicted)
[pka]

7.69±0.70(predicted)
Hazard InformationBack Directory
[Uses]

LY2023-001 is a potent G2019S LRRK2 inhibitor with an IC50 of 12.9 nM. LY2023-001 formed stable hydrogen bonds with Glu1948, and Ala1950 in the G2019S LRRK2 protein[1].
[References]

[1] Shuoyan Tan, et al. Identification of novel LRRK2 inhibitors by structure-based virtual screening and alchemical free energy calculation. Phys Chem Chem Phys. 2024 Jul 24;26(29):19775-19786. DOI:10.1039/d4cp01762e
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